4-diethoxyphosphoryl-2-[(4-nitrophenyl)methyl]-N-(phenylmethyl)-1,3-oxazol-5-amine

Systemtic Name: 4-diethoxyphosphoryl-2-[(4-nitrophenyl)methyl]-N-(phenylmethyl)-1,3-oxazol-5-amine Openeye Name: N-benzyl-4-diethoxyphosphoryl-2-[(4-nitrophenyl)methyl]oxazol-5-amine CAS Name: 4-diethoxyphosphoryl-2-[(4-nitrophenyl)methyl]-N-(phenylmethyl)-5-oxazolamine IUPAC Name: N-benzyl-4-diethoxyphosphoryl-2-[(4-nitrophenyl)methyl]-1,3-oxazol-5-amine Traditional Name: benzyl-[4-diethoxyphosphoryl-2-(4-nitrobenzyl)oxazol-5-yl]amine Formula: C21H24N3O6P MolecularWeight: 445.405521

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=C(OC(=N1)CC2=CC=C(C=C2)[N+](=O)[O-])NCC3=CC=CC=C3)OCC

Isomeric SMILES

CCOP(=O)(C1=C(OC(=N1)CC2=CC=C(C=C2)[N+](=O)[O-])NCC3=CC=CC=C3)OCC

InChI

InChI=1S/C21H24N3O6P/c1-3-28-31(27,29-4-2)21-20(22-15-17-8-6-5-7-9-17)30-19(23-21)14-16-10-12-18(13-11-16)24(25)26/h5-13,22H,3-4,14-15H2,1-2H3